4-azanyl-N-[4-(4-nitrophenyl)sulfanylphenyl]butanamide

Systemtic Name: 4-azanyl-N-[4-(4-nitrophenyl)sulfanylphenyl]butanamide Openeye Name: 4-amino-N-[4-(4-nitrophenyl)sulfanylphenyl]butanamide CAS Name: 4-amino-N-[4-[(4-nitrophenyl)thio]phenyl]butanamide IUPAC Name: 4-amino-N-[4-(4-nitrophenyl)sulfanylphenyl]butanamide Traditional Name: 4-amino-N-[4-[(4-nitrophenyl)thio]phenyl]butyramide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCCN)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCCN)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S/c17-11-1-2-16(20)18-12-3-7-14(8-4-12)23-15-9-5-13(6-10-15)19(21)22/h3-10H,1-2,11,17H2,(H,18,20)